methyl 4-[2-oxidanylidene-3-(2-oxidanylidenepropyl)-4-piperidin-4-yl-benzimidazol-1-yl]piperidine-1-carboxylate

Systemtic Name: methyl 4-[2-oxidanylidene-3-(2-oxidanylidenepropyl)-4-piperidin-4-yl-benzimidazol-1-yl]piperidine-1-carboxylate Openeye Name: methyl 4-[3-acetonyl-2-oxo-4-(4-piperidyl)benzimidazol-1-yl]piperidine-1-carboxylate CAS Name: 4-[2-oxo-3-(2-oxopropyl)-4-(4-piperidinyl)-1-benzimidazolyl]-1-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 4-[2-oxo-3-(2-oxopropyl)-4-piperidin-4-ylbenzimidazol-1-yl]piperidine-1-carboxylate Traditional Name: 4-[3-acetonyl-2-keto-4-(4-piperidyl)benzimidazol-1-yl]piperidine-1-carboxylic acid methyl ester Formula: C22H30N4O4 MolecularWeight: 414.498

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CN1C2=C(C=CC=C2N(C1=O)C3CCN(CC3)C(=O)OC)C4CCNCC4

Isomeric SMILES

CC(=O)CN1C2=C(C=CC=C2N(C1=O)C3CCN(CC3)C(=O)OC)C4CCNCC4

InChI

InChI=1S/C22H30N4O4/c1-15(27)14-25-20-18(16-6-10-23-11-7-16)4-3-5-19(20)26(21(25)28)17-8-12-24(13-9-17)22(29)30-2/h3-5,16-17,23H,6-14H2,1-2H3